4-but-2-ynoxybut-2-ynyl 2-(4-ethoxyphenyl)-3-methyl-butanoate

Systemtic Name: 4-but-2-ynoxybut-2-ynyl 2-(4-ethoxyphenyl)-3-methyl-butanoate Openeye Name: 4-but-2-ynoxybut-2-ynyl 2-(4-ethoxyphenyl)-3-methyl-butanoate CAS Name: 2-(4-ethoxyphenyl)-3-methylbutanoic acid 4-but-2-ynoxybut-2-ynyl ester IUPAC Name: 4-but-2-ynoxybut-2-ynyl 2-(4-ethoxyphenyl)-3-methylbutanoate Traditional Name: 3-methyl-2-p-phenetyl-butyric acid 4-but-2-ynoxybut-2-ynyl ester Formula: C21H26O4 MolecularWeight: 342.42874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C(C)C)C(=O)OCC#CCOCC#CC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C(C)C)C(=O)OCC#CCOCC#CC

InChI

InChI=1S/C21H26O4/c1-5-7-14-23-15-8-9-16-25-21(22)20(17(3)4)18-10-12-19(13-11-18)24-6-2/h10-13,17,20H,6,14-16H2,1-4H3